CID 146599368

2434852-77-2

Structural Information

Molecular Formula

C₁₅H₂₅NO₃

SMILES

CC(C)(C)OC(=O)N(C)C1CCC2(CC1)CC(=O)C2

InChI

InChI=1S/C15H25NO3/c1-14(2,3)19-13(18)16(4)11-5-7-15(8-6-11)9-12(17)10-15/h11H,5-10H2,1-4H3

InChIKey

OODLNPSLFMQDFU-UHFFFAOYSA-N

Compound name

tert-butyl N-methyl-N-(2-oxospiro[3.5]nonan-7-yl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 35
Patents: 267.18344 Da
Monoisotopic Mass: 1.9
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]+	268.190716	163.3
[M+Na]+	290.172658	165.6
[M-H]-	266.176164	169.1
[M+NH4]+	285.217263	175.8
[M+K]+	306.146598	168.9
[M+H-H2O]+	250.180700	152.8
[M+HCOO]-	312.181641	179.5
[M+CH3COO]-	326.197291	204.4
[M+Na-2H]-	288.158106	165.3
[M]+	267.18289142	170.2
[M]-	267.18398858	170.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe