CID 68451901

Tert-butyl n-[(1-aminocyclopropyl)methyl]carbamate

Structural Information

Molecular Formula
C9H18N2O2
SMILES
CC(C)(C)OC(=O)NCC1(CC1)N
InChI
InChI=1S/C9H18N2O2/c1-8(2,3)13-7(12)11-6-9(10)4-5-9/h4-6,10H2,1-3H3,(H,11,12)
InChIKey
YSKANSLBXDBPSZ-UHFFFAOYSA-N
Compound name
tert-butyl N-[(1-aminocyclopropyl)methyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

43
Patents

186.13683 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.14411 141.4
[M+Na]+ 209.12605 149.0
[M-H]- 185.12955 145.7
[M+NH4]+ 204.17065 157.7
[M+K]+ 225.09999 147.9
[M+H-H2O]+ 169.13409 137.1
[M+HCOO]- 231.13503 163.8
[M+CH3COO]- 245.15068 188.6
[M+Na-2H]- 207.11150 147.8
[M]+ 186.13628 143.9
[M]- 186.13738 143.9
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

patents stripe