CID 129159761

1662687-76-4

Structural Information

Molecular Formula

C₂₃H₂₅NO₃

SMILES

CC1=C2C=C(C=C(C2=CC=C1)OCC3=CC=CC=C3)NC(=O)OC(C)(C)C

InChI

InChI=1S/C23H25NO3/c1-16-9-8-12-19-20(16)13-18(24-22(25)27-23(2,3)4)14-21(19)26-15-17-10-6-5-7-11-17/h5-14H,15H2,1-4H3,(H,24,25)

InChIKey

DKNNZNFXEAXOGR-UHFFFAOYSA-N

Compound name

tert-butyl N-(8-methyl-4-phenylmethoxynaphthalen-2-yl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 363.18344 Da
Monoisotopic Mass: 5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	364.190716	189.9
[M+Na]+	386.172658	196.0
[M-H]-	362.176164	197.2
[M+NH4]+	381.217263	203.2
[M+K]+	402.146598	192.0
[M+H-H2O]+	346.180700	181.0
[M+HCOO]-	408.181641	210.0
[M+CH3COO]-	422.197291	219.7
[M+Na-2H]-	384.158106	194.2
[M]+	363.18289142	193.4
[M]-	363.18398858	193.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe