CID 21834643

Pyrrolidin-2-ylmethyl-carbamic acid tert-butyl ester

Structural Information

Molecular Formula
C10H20N2O2
SMILES
CC(C)(C)OC(=O)NCC1CCCN1
InChI
InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-7-8-5-4-6-11-8/h8,11H,4-7H2,1-3H3,(H,12,13)
InChIKey
DPJPFGHHTJLWQQ-UHFFFAOYSA-N
Compound name
tert-butyl N-(pyrrolidin-2-ylmethyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

397
Patents

200.15248 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.15976 149.4
[M+Na]+ 223.14170 153.5
[M-H]- 199.14520 149.5
[M+NH4]+ 218.18630 168.0
[M+K]+ 239.11564 152.3
[M+H-H2O]+ 183.14974 143.3
[M+HCOO]- 245.15068 167.7
[M+CH3COO]- 259.16633 182.3
[M+Na-2H]- 221.12715 152.2
[M]+ 200.15193 146.1
[M]- 200.15303 146.1
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