CID 11275525

1-chloronaphthalene-2-carbaldehyde

Structural Information

Molecular Formula
C11H7ClO
SMILES
C1=CC=C2C(=C1)C=CC(=C2Cl)C=O
InChI
InChI=1S/C11H7ClO/c12-11-9(7-13)6-5-8-3-1-2-4-10(8)11/h1-7H
InChIKey
DUKJZYZDOKKAMU-UHFFFAOYSA-N
Compound name
1-chloronaphthalene-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

488
Patents

190.01854 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.025816 134.6
[M+Na]+ 213.007758 145.7
[M-H]- 189.011264 139.7
[M+NH4]+ 208.052363 156.6
[M+K]+ 228.981698 140.6
[M+H-H2O]+ 173.015800 129.9
[M+HCOO]- 235.016741 154.4
[M+CH3COO]- 249.032391 182.1
[M+Na-2H]- 210.993206 143.3
[M]+ 190.01799142 137.7
[M]- 190.01908858 137.7
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