CID 11127248

Cp-101537

Structural Information

Molecular Formula
C10H18N2O2
SMILES
CC(C)(C)OC(=O)NC1[C@H]2[C@@H]1CNC2
InChI
InChI=1S/C10H18N2O2/c1-10(2,3)14-9(13)12-8-6-4-11-5-7(6)8/h6-8,11H,4-5H2,1-3H3,(H,12,13)/t6-,7+,8?
InChIKey
QIYOMZXJQAKHEK-DHBOJHSNSA-N
Compound name
tert-butyl N-[(1S,5R)-3-azabicyclo[3.1.0]hexan-6-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

480
Patents

198.13683 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.14411 147.5
[M+Na]+ 221.12605 155.7
[M-H]- 197.12955 150.0
[M+NH4]+ 216.17065 162.9
[M+K]+ 237.09999 152.0
[M+H-H2O]+ 181.13409 142.2
[M+HCOO]- 243.13503 165.7
[M+CH3COO]- 257.15068 186.7
[M+Na-2H]- 219.11150 151.7
[M]+ 198.13628 148.7
[M]- 198.13738 148.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe