CID 70700531

1932783-96-4

Structural Information

Molecular Formula
C10H18N2O2
SMILES
CC(C)(C)OC(=O)N[C@]12C[C@H]1CNC2
InChI
InChI=1S/C10H18N2O2/c1-9(2,3)14-8(13)12-10-4-7(10)5-11-6-10/h7,11H,4-6H2,1-3H3,(H,12,13)/t7-,10-/m0/s1
InChIKey
IJHTZGBRXSYOMG-XVKPBYJWSA-N
Compound name
tert-butyl N-[(1R,5S)-3-azabicyclo[3.1.0]hexan-1-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

198.13683 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.144106 148.3
[M+Na]+ 221.126048 156.3
[M-H]- 197.129554 150.7
[M+NH4]+ 216.170653 165.3
[M+K]+ 237.099988 153.6
[M+H-H2O]+ 181.134090 143.9
[M+HCOO]- 243.135031 166.2
[M+CH3COO]- 257.150681 185.2
[M+Na-2H]- 219.111496 154.3
[M]+ 198.13628142 149.6
[M]- 198.13737858 149.6
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

patents stripe