CID 11332481

Cyclopent-1-ene-1-carbonyl chloride

Structural Information

Molecular Formula
C6H7ClO
SMILES
C1CC=C(C1)C(=O)Cl
InChI
InChI=1S/C6H7ClO/c7-6(8)5-3-1-2-4-5/h3H,1-2,4H2
InChIKey
UPRHYURICVZODA-UHFFFAOYSA-N
Compound name
cyclopentene-1-carbonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

40
Patents

130.01854 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.02582 124.3
[M+Na]+ 153.00776 132.6
[M-H]- 129.01126 127.8
[M+NH4]+ 148.05236 148.7
[M+K]+ 168.98170 130.2
[M+H-H2O]+ 113.01580 120.2
[M+HCOO]- 175.01674 143.8
[M+CH3COO]- 189.03239 168.7
[M+Na-2H]- 150.99321 129.0
[M]+ 130.01799 124.2
[M]- 130.01909 124.2
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