CID 165699303

2408965-70-6

Structural Information

Molecular Formula
C16H23NO4
SMILES
CC(C)(C)OC(=O)NC1(CCC2=C1C=C(C=C2)OC)CO
InChI
InChI=1S/C16H23NO4/c1-15(2,3)21-14(19)17-16(10-18)8-7-11-5-6-12(20-4)9-13(11)16/h5-6,9,18H,7-8,10H2,1-4H3,(H,17,19)
InChIKey
UYBRGCOPAGAILZ-UHFFFAOYSA-N
Compound name
tert-butyl N-[1-(hydroxymethyl)-6-methoxy-2,3-dihydroinden-1-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

293.16272 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.17000 168.0
[M+Na]+ 316.15194 176.0
[M+NH4]+ 311.19654 175.6
[M+K]+ 332.12588 171.8
[M-H]- 292.15544 167.7
[M+Na-2H]- 314.13739 171.7
[M]+ 293.16217 168.9
[M]- 293.16327 168.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.