CID 114293371

1507977-56-1

Structural Information

Molecular Formula
C10H18ClNO2
SMILES
CC(C)(C)OC(=O)N(CCCl)C1CC1
InChI
InChI=1S/C10H18ClNO2/c1-10(2,3)14-9(13)12(7-6-11)8-4-5-8/h8H,4-7H2,1-3H3
InChIKey
ODZAKGHQEOJHRP-UHFFFAOYSA-N
Compound name
tert-butyl N-(2-chloroethyl)-N-cyclopropylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.1026 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.10988 147.9
[M+Na]+ 242.09182 155.9
[M-H]- 218.09532 153.5
[M+NH4]+ 237.13642 163.1
[M+K]+ 258.06576 153.5
[M+H-H2O]+ 202.09986 142.7
[M+HCOO]- 264.10080 166.1
[M+CH3COO]- 278.11645 194.7
[M+Na-2H]- 240.07727 152.1
[M]+ 219.10205 154.9
[M]- 219.10315 154.9
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.